Benzene,1,1'-sulfonylbis[3-azido- supplier

Name
3,3'-DIAZIDODIPHENYL SULFONE
EINECS 278-300-8
CAS No. 75742-13-1
Article Data1
CAS DataBase
Density 1.4492 (rough estimate)
Solubility
Melting Point 110-114 °C
Formula C₁₂H₈N₆O₂S
Boiling Point
Molecular Weight 300.301
Flash Point
Transport Information
Appearance Yellow crystalline powder
Safety 26-36
Risk Codes 20/22-36/37/38
Molecular Structure
Hazard Symbols Xn
Synonyms 3,3'-Diazidodiphenylsulfone;3-Azidophenyl sulfone;1,1'-Sulfonylbis(3-azidobenzene);Bis(3-azidophenyl) sulfone;m-Azidophenyl sulfone;
PSA 142.02000
LogP 4.38932

Benzene,1,1'-sulfonylbis[3-azido- Specification

The Benzene,1,1'-sulfonylbis[3-azido-, with the CAS registry number 75742-13-1, is also known as 3-Azidophenyl sulfone. Its EINECS number is 278-300-8. This chemical's molecular formula is C₁₂H₈N₆O₂S and molecular weight is 300.30. What's more, its IUPAC name is 1-azido-3-(3-azidophenyl)sulfonylbenzene. Its classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].

Physical properties of Benzene,1,1'-sulfonylbis[3-azido- are: (1)ACD/LogP: 3.94; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.94; (4)ACD/LogD (pH 7.4): 3.94; (5)ACD/BCF (pH 5.5): 583.31; (6)ACD/BCF (pH 7.4): 583.31; (7)ACD/KOC (pH 5.5): 3322.27; (8)ACD/KOC (pH 7.4): 3322.27; (9)#H bond acceptors: 8; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 67.24 Å².

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful by inhalation and if swallowed. What's more, the product is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1cc(\N=[N+]=[N-])ccc1)c2cc(/N=[N+]=[N-])ccc2
(2)Std. InChI: InChI=1S/C12H8N6O2S/c13-17-15-9-3-1-5-11(7-9)21(19,20)12-6-2-4-10(8-12)16-18-14/h1-8H
(3)Std. InChIKey: LHCUYYJTVIYFEQ-UHFFFAOYSA-N

Product Name

3,3'-DIAZIDODIPHENYL SULFONE

Benzene,1,1'-sulfonylbis[3-azido- Specification

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